1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine

C5H11F3N2 — CID 129248465

IUPAC1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine
SMILESCCC(NNC)C(F)(F)F
InChIInChI=1S/C5H11F3N2/c1-3-4(10-9-2)5(6,7)8/h4,9-10H,3H2,1-2H3
InChIKeyICQSENFMVYWKNG-UHFFFAOYSA-N
MW156.15 g/mol
LogP1.05
Rot. Bonds3

About 1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine

1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine (PubChem CID 129248465) has the molecular formula C5H11F3N2 and a molecular weight of 156.15 g/mol. Its IUPAC name is 1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine.

Molecular Properties

Compound Name1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine
PubChem CID129248465
Molecular FormulaC5H11F3N2
Molecular Weight156.15 g/mol
Exact Mass156.09
IUPAC Name1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine
SMILESCCC(NNC)C(F)(F)F
InChIInChI=1S/C5H11F3N2/c1-3-4(10-9-2)5(6,7)8/h4,9-10H,3H2,1-2H3
InChIKeyICQSENFMVYWKNG-UHFFFAOYSA-N
XLogP1.05
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.15
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1,1,1-trifluoro-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]butan-2-amine
CID 155459777
1,1,1-trifluoro-N,6-dimethylheptan-2-amine
CID 105029014
2-(ethylamino)-3,3,3-trifluoropropan-1-ol
CID 83815516
2-(methylamino)butane-1,1,1-triol;hydrochloride
CID 175087154
(2S)-1,1,1-trifluoro-3-iodo-N-propylpropan-2-amine
CID 159756276
1,1,1-trifluoro-N-methyl-4-methylsulfanylbutan-2-amine
CID 55272632
(1-iodo-2-methylpropan-2-yl) N-(1,1,1-trifluorobutan-2-yl)carbamate
CID 162553733
methane;bis(1,1,1-trifluoro-2-methylbutane)
CID 161468876
[2,6-difluoro-4-[[(2R)-1,1,1-trifluorobutan-2-yl]amino]phenyl]-[(2-methylpropan-2-yl)oxy]methanol
CID 146614979
1-fluoro-1-(1,1,2,2,2-pentafluoroethoxy)propane
CID 174963973
3,4,4,4-tetrafluoro-N-methylbutan-1-amine
CID 84731464
N-ethyl-1,1,1-trifluoroheptan-2-amine
CID 66204149

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine?
The IUPAC name of 1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine (CID 129248465) is 1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine.
What is the SMILES notation for 1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine?
The canonical SMILES for 1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine is CCC(NNC)C(F)(F)F.
What is the InChIKey of 1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine?
The InChIKey is ICQSENFMVYWKNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11F3N2/c1-3-4(10-9-2)5(6,7)8/h4,9-10H,3H2,1-2H3.
What are the key properties of 1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine?
1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine has a molecular weight of 156.15 g/mol, XLogP of 1.05, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(1,1,1-trifluorobutan-2-yl)hydrazine is sourced from PubChem (CID 129248465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).